769143-53-5
2-HYDROXY-5-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
Name2-HYDROXY-5-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
1Identification
【Name】
2-HYDROXY-5-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
【CAS】
【MDL】
MFCD06199441
【English Synonyms】
【Formula】
C16 H17 N3 O2 S
【MolWeight】
315.395
【Inchi】
InChI=1S/C16H17N3O2S/c1-11-4-3-5-13(8-11)18-16(22)19-17-10-12-9-14(21-2)6-7-15(12)20/h3-10,20H,1-2H3,(H2,18,19,22)/b17-10+
【InChIKey】
InChIKey=QAWRNDBODBZTEG-LICLKQGHSA-N
【SMILES】
Cc1cccc(c1)NC(=S)N/N=C/c2cc(ccc2O)OC
【MOL File】
2-HYDROXY-5-METHOXYB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-HYDROXY-5-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE.cml